CID 1393700

60277-22-7

Structural Information

Molecular Formula

C₁₅H₁₄O₃

SMILES

COC1=CC=C(C=C1)C2=CC=C(C=C2)CC(=O)O

InChI

InChI=1S/C15H14O3/c1-18-14-8-6-13(7-9-14)12-4-2-11(3-5-12)10-15(16)17/h2-9H,10H2,1H3,(H,16,17)

InChIKey

KJOHEDXEFMKOEF-UHFFFAOYSA-N

Compound name

2-[4-(4-methoxyphenyl)phenyl]acetic acid

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 25
Patents: 242.0943 Da
Monoisotopic Mass: 3.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	243.10158	154.1
[M+Na]+	265.08352	168.4
[M+NH4]+	260.12812	162.2
[M+K]+	281.05746	161.4
[M-H]-	241.08702	157.9
[M+Na-2H]-	263.06897	162.8
[M]+	242.09375	157.3
[M]-	242.09485	157.3

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe